Crystallography Open Database

Information card for entry 7003200

Preview

Coordinates	7003200.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11.5 H16 Cl Cu N10 O11
Calculated formula	C11.5 H14 Cl Cu N10 O11
Title of publication	Guanine-containing copper(ii) complexes: synthesis, X-ray structures and magnetic properties
Authors of publication	Mastropietro, Teresa F.; Armentano, Donatella; Grisolia, Ettore; Zanchini, Claudia; Lloret, Francesc; Julve, Miguel; De Munno, Giovanni
Journal of publication	Dalton Transactions
Year of publication	2008
Journal issue	4
Pages of publication	514 - 520
a	24.6576 ± 0.0009 Å
b	13.418 ± 0.0004 Å
c	12.8429 ± 0.0004 Å
α	90°
β	112.245 ± 0.001°
γ	90°
Cell volume	3932.9 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0506
Residual factor for significantly intense reflections	0.038
Weighted residual factors for significantly intense reflections	0.1054
Weighted residual factors for all reflections included in the refinement	0.1134
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7003200.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7003200.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7003200.cif
1173	2010-05-16	cif/7/: adding data from Dalton-Trans-2008, New-J-Chem-2008, Org-Biomol-Chem-2008 and RSC-2008 processing.	7003200.cif